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CAS 32476-67-8

:

(3alpha,5beta,8xi,9xi)-3-[(2,6-dideoxy-3-O-methyl-beta-D-glycero-hexopyranosyl)oxy]-5,14-dihydroxycard-20(22)-enolide

Description:
The chemical substance known as (3alpha,5beta,8xi,9xi)-3-[(2,6-dideoxy-3-O-methyl-beta-D-glycero-hexopyranosyl)oxy]-5,14-dihydroxycard-20(22)-enolide, with the CAS number 32476-67-8, is a complex organic compound belonging to the class of cardenolides, which are a type of steroid glycoside. This compound features multiple hydroxyl groups, contributing to its solubility and reactivity, and a glycosidic moiety that enhances its biological activity. The presence of a cardenolide backbone suggests potential pharmacological properties, particularly in relation to cardiac function, as many cardenolides are known for their effects on the heart. The specific stereochemistry indicated by the nomenclature suggests a precise three-dimensional arrangement of atoms, which is crucial for its biological interactions. Additionally, the presence of a dideoxy sugar moiety may influence its metabolic stability and bioavailability. Overall, this compound exemplifies the intricate relationship between structure and function in bioactive natural products.
Formula:C30H46O8
InChI:InChI=1/C30H46O8/c1-17-26(32)23(35-4)14-25(37-17)38-19-5-9-27(2)21-6-10-28(3)20(18-13-24(31)36-16-18)8-12-30(28,34)22(21)7-11-29(27,33)15-19/h13,17,19-23,25-26,32-34H,5-12,14-16H2,1-4H3/t17-,19?,20-,21+,22-,23+,25+,26-,27-,28-,29?,30+/m1/s1
InChI key:InChIKey=XRWQBDJPMXRDOQ-YUUDFPFBSA-N
SMILES:O[C@@]12[C@]3([C@@]([C@]4(C)[C@](O)(CC3)C[C@@H](O[C@H]5C[C@H](OC)[C@H](O)[C@@H](C)O5)CC4)(CC[C@]1(C)[C@](CC2)(C6=CC(=O)OC6)[H])[H])[H]
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